[(2S)-2-ethylhexyl] 4-(dimethylamino)benzoate

Systemtic Name: [(2S)-2-ethylhexyl] 4-(dimethylamino)benzoate Openeye Name: [(2S)-2-ethylhexyl] 4-(dimethylamino)benzoate CAS Name: 4-(dimethylamino)benzoic acid [(2S)-2-ethylhexyl] ester IUPAC Name: [(2S)-2-ethylhexyl] 4-(dimethylamino)benzoate Traditional Name: 4-(dimethylamino)benzoic acid [(2S)-2-ethylhexyl] ester Formula: C17H27NO2 MolecularWeight: 277.40178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1=CC=C(C=C1)N(C)C

Isomeric SMILES

CCCC[C@H](CC)COC(=O)C1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C17H27NO2/c1-5-7-8-14(6-2)13-20-17(19)15-9-11-16(12-10-15)18(3)4/h9-12,14H,5-8,13H2,1-4H3/t14-/m0/s1